In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 11th, 2006 | 21 | Yes |
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 2.32 | 5.91 | -19.39 | 1 | 4 | 0 | 67 | 319.769 | 2 | ↓ |
Mid Mid (pH 6-8) | 3.62 | 4.66 | -41.02 | 0 | 4 | -1 | 70 | 318.761 | 2 | ↓ |